Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB1 | P46663 | 5/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | RXRG | P48443 | 1/20 | 0.34 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13128621 | 0.89 | BDKRB1 (0.53) | BDKRB1HDAC1KDM1ACYP3A4CYP2C9 | |
| SCHEMBL2810040 | 0.89 | BDKRB1 (0.58) | BDKRB1CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL2806049 | 0.83 | BDKRB1 (0.62) | BDKRB1HDAC1CYP3A4KDM4EALDH1A1 | |
| SCHEMBL2805998 | 0.82 | BDKRB1 (0.57) | BDKRB1CNR1CTSLCTSBCTSS | |
| SCHEMBL14865428 | 0.81 | BDKRB1 (0.53) | BDKRB1HDAC1KDM1ACYP3A4CYP2C9 | |
| SCHEMBL2806959 | 0.81 | BDKRB1 (0.59) | BDKRB1HDAC1KDM1ACYP3A4CYP2C9 | |
| SCHEMBL12239078 | 0.80 | BDKRB1 (0.54) | BDKRB1HDAC1KDM1ACYP3A4CYP2C9 | |
| SCHEMBL14865456 | 0.79 | BDKRB1 (0.59) | BDKRB1HDAC1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL764432 | 0.78 | BDKRB1 (0.61) | BDKRB1HDAC1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL185880 | 0.77 | BDKRB1 (0.47) | BDKRB1CYP3A4CYP2C9CYP2C19CTSL |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |